General Information of the Compound
| Compound ID |
CP0477612
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| Compound Name |
5-(6-amino-10-methyl-2-oxa-4,5,11,12-tetrazatricyclo[7.3.0.03,7]dodeca-1(12),3,6,9-tetraen-8-yl)-2-methoxyphenol
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| Structure |
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| Formula |
C15H15N5O3
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| Molecular Weight |
313.317
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| Canonical SMILES |
COc1ccc(cc1O)C1c2c(C)n[nH]c2Oc2[nH]nc(N)c12
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| InChI |
InChI=1S/C15H15N5O3/c1-6-10-11(7-3-4-9(22-2)8(21)5-7)12-13(16)18-20-15(12)23-14(10)19-17-6/h3-5,11,21H,1-2H3,(H,17,19)(H3,16,18,20)
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| InChIKey |
VBKKAFOEYAYEPD-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound